Geometry & MOs

Info

ID:	376802
PubChem CID:	134222828
Reduced:	O2F7H21C22 (1)
Stoich.:	A2B7C21D22 (1)
Weight, g/mol:	592.165998
ΔH_f, kcal/mol:	-396.21
Dipole, Da:	6.01
IP(EA), eV:	-9.83(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[difluoro-[3-fluoro-4-[3-fluoro-4-(trifluoromethoxy)phenyl]phenoxy]methyl]-4-[4-(ethoxymethyl)cyclohexyl]-2,3-difluorobenzene

Drug info:

PubChemData

Smile

CCOCC1CCC(CC1)C2=C(C(=C(C=C2)C(OC3=CC(=C(C(=C3)F)F)F)(F)F)F)F

DOS

IR

Vibrations